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Computational Identification of High-Efficiency Dual-Metal-Atom-Modified Ti-Metal–Organic Frameworks for Photocatalytic CO2 Reduction to Value-Added Chemicals

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Date of Publication:2024-12-24

Journal:CCS Chemistry

ISSN No.:2096-5745

Key Words:computational screening; CO<sub>2</sub> photoreduction; density functional theory; dual-metal-atom-modified Ti-MOFs; structure-activity relationship; value-added chemicals

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